methyl 1-[2-(4-bromanyl-2,6-dimethyl-phenoxy)ethanoyl]pyrrolidine-2-carboxylate

Systemtic Name: methyl 1-[2-(4-bromanyl-2,6-dimethyl-phenoxy)ethanoyl]pyrrolidine-2-carboxylate Openeye Name: methyl 1-[2-(4-bromo-2,6-dimethyl-phenoxy)acetyl]pyrrolidine-2-carboxylate CAS Name: 1-[2-(4-bromo-2,6-dimethylphenoxy)-1-oxoethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(4-bromo-2,6-dimethylphenoxy)acetyl]pyrrolidine-2-carboxylate Traditional Name: 1-[2-(4-bromo-2,6-dimethyl-phenoxy)acetyl]pyrrolidine-2-carboxylic acid methyl ester Formula: C16H20BrNO4 MolecularWeight: 370.2383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)N2CCCC2C(=O)OC)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)N2CCCC2C(=O)OC)C)Br

InChI

InChI=1S/C16H20BrNO4/c1-10-7-12(17)8-11(2)15(10)22-9-14(19)18-6-4-5-13(18)16(20)21-3/h7-8,13H,4-6,9H2,1-3H3